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Bisnorabietane
SpectraBase Compound ID J9CJBWdQHqS
InChI InChI=1S/C32H54/c1-21-7-5-17-31(3)27(21)13-11-25-19-23(9-15-29(25)31)24-10-16-30-26(20-24)12-14-28-22(2)8-6-18-32(28,30)4/h21-30H,5-20H2,1-4H3
InChIKey CJRSZLGGJXEKOQ-UHFFFAOYSA-N
Mol Weight 438.8 g/mol
Molecular Formula C32H54
Exact Mass 438.422552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QgJBteHljv
Name Bisnorabietane
Alternate Name(s) 4b,4'b,8,8'-tetramethyloctacosahydro-2,2'-biphenanthrene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H54
InChI InChI=1S/C32H54/c1-21-7-5-17-31(3)27(21)13-11-25-19-23(9-15-29(25)31)24-10-16-30-26(20-24)12-14-28-22(2)8-6-18-32(28,30)4/h21-30H,5-20H2,1-4H3
InChIKey CJRSZLGGJXEKOQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/pca.868
Molecular Weight 438.784 g/mol
SMILES C1CC2(C(C(C1)C)CCC1C2CCC(C2CCC3C4(CCCC(C4CCC3C2)C)C)C1)C
SPLASH splash10-0a7j-9830000000-fd58f659946440adc650
Source of Spectrum PA-16-448-21
Wiley ID 1789507